[(4-Bromophenyl)methyl][2-(dimethylamino)ethyl]amine
Basic information
- CAS
99862-34-7- Standard SMILES
CN(C)CCNCc1ccc(Br)cc1- InChIKey
LZFYBEIKDOCTHC-UHFFFAOYSA-N- Molecular formula
- C11H17BrN2
- Average molar mass
- 257.17 g/mol
- Monoisotopic mass
- 256.05751
Names & identifiers
- Preferred name
- [(4-Bromophenyl)methyl][2-(dimethylamino)ethyl]amine
- IUPAC
- N-[(4-bromophenyl)methyl]-N',N'-dimethylethane-1,2-diamine
- English name
- N1-(4-broMobenzyl)-N2,N2-diMethylethane-1,2-diaMine
- Molecular formula
- C11H17BrN2
- Molecular weight
- 257.17
Names & synonyms
99862-34-7[(4-bromophenyl)methyl][2-(dimethylamino)ethyl]amineN'-(4-Bromo-benzyl)-N,N-dimethyl-ethane-1,2-diamineMFCD07408130n1-(4-bromobenzyl)-n2,n2-dimethylethane-1,2-diamineN-[(4-bromophenyl)methyl]-N',N'-dimethylethane-1,2-diamineN-[(4-bromophenyl)methyl]-N',N'-dimethyl-ethane-1,2-diamine1-(4-Bromobenzylamino)-2-(dimethylamino)ethaneSCHEMBL3037243ZDA86234SBB101845AKOS000127010
Show more names
N2-[(4-Bromophenyl)methyl]-N1,N1-dimethyl-1,2-ethanediamine1,2-Ethanediamine, N2-[(4-bromophenyl)methyl]-N1,N1-dimethyl-
CS-10006EN300-52572G31016F317152(2-{[(4-bromophenyl)methyl]amino}ethyl)dimethylamineZ86135316N-[(4-Bromophenyl)methyl]-N,N-dimethyl-ethane-1,2-diamine
Database identifiers
- CAS
99862-34-7- PubChem CID
- 3300601
- EC Number
- 127-317-8
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 142
Physicochemical properties
- Boiling point
- 309.8 · 309.8±22.0 °C(Predicted)
- Density
- 1.26 · 1.260±0.06 g/cm3(Predicted)
- pka
- 9.25 · 9.25±0.28(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2921599090 · 2921599090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2921599090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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